methyl 4-cyano-3-methyl-5-[2-(4-methyl-2-nitro-phenoxy)ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 4-cyano-3-methyl-5-[2-(4-methyl-2-nitro-phenoxy)ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 4-cyano-3-methyl-5-[[2-(4-methyl-2-nitro-phenoxy)acetyl]amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[2-(4-methyl-2-nitrophenoxy)-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-cyano-3-methyl-5-[[2-(4-methyl-2-nitrophenoxy)acetyl]amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[[2-(4-methyl-2-nitro-phenoxy)acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C17H15N3O6S MolecularWeight: 389.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O6S/c1-9-4-5-13(12(6-9)20(23)24)26-8-14(21)19-16-11(7-18)10(2)15(27-16)17(22)25-3/h4-6H,8H2,1-3H3,(H,19,21)